SCHEMBL19082236

SCHEMBL19082236

c1ccc2c(-c3c4ccccc4c(-c4ccc(-c5ccc6sc7cc8sc9ccc%10ccccc%10c9c8cc7c6c5)cc4)c4ccccc34)cccc2c1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.34
CA1 P00915 4/20 0.34
CA2 P00918 4/20 0.34
CA9 Q16790 4/20 0.34
NQO2 P16083 2/20 0.33
NQO1 P15559 1/20 0.33
CDK4 P11802 1/20 0.31
CCND1 P24385 1/20 0.31
ALK Q9UM73 1/20 0.30
PIM3 Q86V86 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL19082105 0.95 NQO2 (0.34) CA12CA1CA2CA9NQO2
SCHEMBL17945337 0.95 CA12 (0.36) CA12CA1CA2CA9NQO2
SCHEMBL19082255 0.94 CA12 (0.33) CA12CA1CA2CA9NQO2
SCHEMBL19082275 0.94 CA12 (0.33) CA12CA1CA2CA9NQO2
SCHEMBL19082374 0.94 PIM1 (0.32) CA12CA1CA2CA9NQO2
SCHEMBL19109279 0.91 NQO1 (0.34) CA12CA1CA2CA9NQO2
SCHEMBL19082227 0.91 ALOX5 (0.34) CA12CA1CA2CA9NQO2
SCHEMBL19082253 0.91 CA12 (0.34) CA12CA1CA2CA9NQO2
SCHEMBL19082269 0.91 CA12 (0.34) CA12CA1CA2CA9NQO2
SCHEMBL17945241 0.90 ALOX5 (0.37) CA12CA1CA2CA9PIM3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10553800-B2 Condensed cyclic compound and an organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-02-04 US disclosed
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10553800-B2 Condensed cyclic compound and an organic light-emitting device including the same CRY1, CRY2, CCNT1 CA12 1240/4885CA1 1455/4885CA2 3066/4885
US-20170194572-A1 CONDENSED CYCLIC COMPOUND AND AN ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNT1 CA12 1240/4885CA1 1455/4885CA2 3066/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.